N-[(4-dimethylaminophenyl)methyl]-2-(4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)ethanamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-2-(4-oxidanylidene-5H-pyrimido[5,4-b]indol-3-yl)ethanamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-2-(4-oxo-5H-pyrimido[5,4-b]indol-3-yl)acetamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-2-(4-oxo-5H-pyrimido[5,4-b]indol-3-yl)acetamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-2-(4-oxo-5H-pyrimido[5,4-b]indol-3-yl)acetamide Traditional Name: N-[4-(dimethylamino)benzyl]-2-(4-keto-5H-pyrimid[5,4-b]indol-3-yl)acetamide Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)CN2C=NC3=C(C2=O)NC4=CC=CC=C43

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)CN2C=NC3=C(C2=O)NC4=CC=CC=C43

InChI

InChI=1S/C21H21N5O2/c1-25(2)15-9-7-14(8-10-15)11-22-18(27)12-26-13-23-19-16-5-3-4-6-17(16)24-20(19)21(26)28/h3-10,13,24H,11-12H2,1-2H3,(H,22,27)